In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 20 | Yes |
Popular Name: 4-fluoro-3-[(2-methylimidazol-1-yl)methyl]benzothiophene-2-carboxylic 4-fluoro-3-[(2-methylimidazol-1-…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.50 | 9.54 | -41.4 | 1 | 4 | 0 | 59 | 290.319 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.50 | 9.07 | -50.5 | 0 | 4 | -1 | 58 | 289.311 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.